SCHEMBL9515082

SCHEMBL9515082

O=C(c1cccnn1)[N+](Cl)Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.53
AHR P35869 1/20 0.46
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
CES1 P23141 2/20 0.41
TBXA2R P21731 1/20 0.39
FAAH O00519 1/20 0.39
CTNNB1 P35222 1/20 0.37
WNT3A P56704 1/20 0.37
CYP1A2 P05177 1/20 0.36
SNCA P37840 1/20 0.35
ABL1 P00519 1/20 0.35
CES2 O00748 1/20 0.34
LMNA P02545 1/20 0.33
NAPRT Q6XQN6 1/20 0.33
P4HTM Q9NXG6 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GOT1 P17174 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
AR P10275 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3721094 0.78
SCHEMBL8977638 0.78 P2RX7 (0.61) P2RX7AHRKMT2AMEN1CES1
SCHEMBL28293 0.76
SCHEMBL2538334 0.76
SCHEMBL31605465 0.76
SCHEMBL24786819 0.74 P2RX7 (0.57) P2RX7AHRKMT2AMEN1CES1
SCHEMBL667511 0.74
SCHEMBL971441 0.74
SCHEMBL22288333 0.74 P2RX7 (0.57) P2RX7AHRKMT2AMEN1CES1
Hydrochloric Acid SCHEMBL11797023 0.74 P2RX7 (0.57) P2RX7AHRKMT2AMEN1CES1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0359188-B1 Dyeing and printing process of cellulose fibres in the absence of alkali or reducing agents HOECHST AG (DE) 1993-12-15 EP disclosed
US-5131913-A PRODUCTION OF PATTERN EFFECTS WHEN DYEING OR PRINTING TEXTILE MATERIAL IN THE ABSENCE OF ALKALI OR REDUCING AGENTS: CATIONIZATION AND OXIDIZED IN A PATTERN BEFORE DYEING HOECHST AKTIENGESELLSCHAFT (DE) 1992-07-21 US disclosed
EP-0284010-B1 PROCESS FOR ALKALI-FREE DYEING AND PRINTING HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-26 EP disclosed
US-4988365-A Eliminates need for alkali or reducing agent for subsequent dyeing HOECHST AKTIENGESELLSCHAFT (DE) 1991-01-29 US disclosed
EP-0402879-A1 Process to obtain design effects by dying or printing of textile material without alkali or reductor agent HOECHST AKTIENGESELLSCHAFT (DE) 1990-12-19 EP disclosed
EP-0359188-A2 Dyeing and printing process of cellulose fibres in the absence of alkali or reducing agents HOECHST AKTIENGESELLSCHAFT (DE) 1990-03-21 EP disclosed
EP-0359104-A2 Uneven dyeing process of cellulose fibres in the absence of alkali or reducing agents HOECHST AKTIENGESELLSCHAFT (DE) 1990-03-21 EP disclosed
EP-0358174-A2 Thermofixation process for dyeing and printing with reactive dyes or water soluble sulfur dyes in the absence of alkali or reducing agents HOECHST AKTIENGESELLSCHAFT (DE) 1990-03-14 EP disclosed
US-4806126-A PRETREATING WITH WETTING AGENT AND REACTION PRODUCT OF POLYETHYLENIMINE AND BIFUNCTIONAL ALKLATING AGENT HOECHST AKTIENGESELLSCHAFT (DE) 1989-02-21 US disclosed
EP-0284010-A2 Process for alkali-free dyeing and printing HOECHST AKTIENGESELLSCHAFT (DE) 1988-09-28 EP disclosed